Geometry & MOs

Info

ID:	75146
PubChem CID:	48423086
Reduced:	O3N4C22H24 (1)
Stoich.:	A3B4C22D24 (1)
Weight, g/mol:	313.179027
ΔH_f, kcal/mol:	-55.46
Dipole, Da:	4.1
IP(EA), eV:	-9.36(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[[3-(imidazol-1-ylmethyl)phenyl]methyl]propanamide

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)NCC2=CC(=CC=C2)CN3C=CN=C3

DOS

IR

Vibrations