Geometry & MOs

Info

ID:

145154

PubChem CID:

53471645

Reduced:

NO3F7C15H22 (1)

Stoich.:

AB3C7D15E22 (1)

Weight, g/mol:

770.354031

ΔHf, kcal/mol:

-524.89

Dipole, Da:

4.87

IP(EA), eV:

-10.76(-0.4)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2S)-2-amino-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-3-(4-hydroxyphenyl)propanamide

Drug info:

PubChemData

Smile

CC(C)CCOC(=O)[C@H](CC(C)C)NC(=O)C(C(C(F)(F)F)(F)F)(F)F

DOS

IR

Vibrations