Geometry & MOs

Info

ID:	75659
PubChem CID:	48423809
Reduced:	O3N4C21H22 (1)
Stoich.:	A3B4C21D22 (1)
Weight, g/mol:	299.163377
ΔH_f, kcal/mol:	-50.77
Dipole, Da:	5.35
IP(EA), eV:	-9.34(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)NC2=CC=CC(=C2)CN3C=CN=C3

DOS

IR

Vibrations