Geometry & MOs

Info

ID:	340163
PubChem CID:	127262172
Reduced:	N4O4C23H34 (1)
Stoich.:	A4B4C23D34 (1)
Weight, g/mol:	376.211055
ΔH_f, kcal/mol:	-180.47
Dipole, Da:	10.72
IP(EA), eV:	-9.19(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[[(2S)-6-amino-1-oxohexan-2-yl]-[(2S)-2-formamidopropanoyl]amino]-3-phenylpropanamide

Drug info:

PubChemData

Smile

CC(C)C[C@@H](C(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](CC2=CC=CC=C2)C(=O)N)NC(=O)C

DOS

IR

Vibrations