Geometry & MOs

Info

ID:	414446
PubChem CID:	135087404
Reduced:	N3O3C18H25 (1)
Stoich.:	A3B3C18D25 (1)
Weight, g/mol:	386.174276
ΔH_f, kcal/mol:	-92.65
Dipole, Da:	3.3
IP(EA), eV:	-8.61(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-acetylindol-1-yl)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide

Drug info:

PubChemData

Smile

CN1C=NC=C1CN(CCO)C(=O)CCCC2=CC=C(C=C2)OC

DOS

IR

Vibrations