Geometry & MOs

Info

ID:	43166
PubChem CID:	10318982
Reduced:	O3N7H17C20 (1)
Stoich.:	A3B7C17D20 (1)
Weight, g/mol:	403.174336
ΔH_f, kcal/mol:	28.25
Dipole, Da:	5.26
IP(EA), eV:	-8.95(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-[[(2R)-2-[2-(hydroxyamino)-2-oxoethyl]-4-methylpentanoyl]amino]-4-(1H-indol-2-yl)-4-oxobutanoic acid

Drug info:

PubChemData

Smile

CNC(=O)C1=NC=CC(=C1)OC2=CC=C(C=C2)NC(=O)NC3=CC4=NNN=C4C=C3

DOS

IR

Vibrations