Geometry & MOs

Info

ID:	234619
PubChem CID:	92303175
Reduced:	O2N5C22H27 (1)
Stoich.:	A2B5C22D27 (1)
Weight, g/mol:	393.216475
ΔH_f, kcal/mol:	-41.27
Dipole, Da:	4.18
IP(EA), eV:	-9.2(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[(1R)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-2-(carbamoylamino)-4-methylpentanamide

Drug info:

PubChemData

Smile

CC(C)C[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C2=NC3=CC=CC=C3N2)NC(=O)N

DOS

IR

Vibrations