Geometry & MOs

Info

ID:	414000
PubChem CID:	135086953
Reduced:	NC8H9 (2)
Stoich.:	AB8C9 (2)
Weight, g/mol:	420.183778
ΔH_f, kcal/mol:	92.42
Dipole, Da:	2.7
IP(EA), eV:	-8.2(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-1-phenylethyl)-1-(naphthalen-2-ylmethyl)indole-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)N=CC1=C(C2=CC=CC=C2N1C)C#C

DOS

IR

Vibrations