Geometry & MOs

Info

ID:	75719
PubChem CID:	48423895
Reduced:	O3N4C22H24 (1)
Stoich.:	A3B4C22D24 (1)
Weight, g/mol:	313.179027
ΔH_f, kcal/mol:	-56.01
Dipole, Da:	4.51
IP(EA), eV:	-9.27(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]propanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations