Geometry & MOs

Info

ID:	173778
PubChem CID:	75680962
Reduced:	N3O4C20H27 (1)
Stoich.:	A3B4C20D27 (1)
Weight, g/mol:	378.218152
ΔH_f, kcal/mol:	-149.82
Dipole, Da:	3.15
IP(EA), eV:	-8.72(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N-[(4-methoxyphenyl)-phenylmethyl]-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)propanamide

Drug info:

PubChemData

Smile

CC(C)C1CC(=O)NC(N1)C2CCCN2C(=O)CC3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations