Geometry & MOs

Info

ID:	344293
PubChem CID:	127267469
Reduced:	N3O3C16H21 (1)
Stoich.:	A3B3C16D21 (1)
Weight, g/mol:	312.158626
ΔH_f, kcal/mol:	-123.46
Dipole, Da:	0.55
IP(EA), eV:	-9.62(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-hydroxy-1-(3-methylimidazol-4-yl)ethyl]-4,5-dimethyl-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)C(=O)N2CC(C(C2)C(=O)N)C(=O)N

DOS

IR

Vibrations