Geometry & MOs

Info

ID:	287997
PubChem CID:	104306023
Reduced:	N2O2C13H20 (1)
Stoich.:	A2B2C13D20 (1)
Weight, g/mol:	268.121178
ΔH_f, kcal/mol:	-87.42
Dipole, Da:	4.55
IP(EA), eV:	-8.77(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(hydroxymethyl)phenyl]-2,3-dihydro-1H-indole-5-carboxamide

Drug info:

PubChemData

Smile

CCC(C)NCC(=O)NC1=CC=C(C=C1)CO

DOS

IR

Vibrations