Geometry & MOs

Info

ID:	413857
PubChem CID:	135086808
Reduced:	NOC13H18 (2)
Stoich.:	ABC13D18 (2)
Weight, g/mol:	368.173607
ΔH_f, kcal/mol:	-50.28
Dipole, Da:	1.19
IP(EA), eV:	-8.01(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-(2-hydroxyethyl)-5,6-dimethoxy-1-methylindole-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)N=CC1=C(C2=CC=CC=C2N1C)C#CCCCCCCCCC(=O)OC

DOS

IR

Vibrations