Geometry & MOs

Info

ID:	335514
PubChem CID:	127254376
Reduced:	N3O3C19H19 (1)
Stoich.:	A3B3C19D19 (1)
Weight, g/mol:	401.210327
ΔH_f, kcal/mol:	-52.36
Dipole, Da:	2.89
IP(EA), eV:	-8.1(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-4-pyrrol-1-ylbutanamide

Drug info:

PubChemData

Smile

CN1C=CC2=C1C=CC(=C2)NC(=O)NC3=CC4=C(C=C3)OCCCO4

DOS

IR

Vibrations