Geometry & MOs

Info

ID:	335788
PubChem CID:	127254650
Reduced:	FO2N4C21H23 (1)
Stoich.:	AB2C4D21E23 (1)
Weight, g/mol:	386.210661
ΔH_f, kcal/mol:	-39.07
Dipole, Da:	4.59
IP(EA), eV:	-8.88(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(S)-1H-benzimidazol-2-yl(phenyl)methyl]-6-pyrrol-1-ylhexanamide

Drug info:

PubChemData

Smile

C1CN(CCN1CCOC2=CC=C(C=C2)F)CN3C(=O)C4=CC=CC=C4C=N3

DOS

IR

Vibrations