Geometry & MOs

Info

ID:	74996
PubChem CID:	48422836
Reduced:	N2O3C17H22 (1)
Stoich.:	A2B3C17D22 (1)
Weight, g/mol:	313.179027
ΔH_f, kcal/mol:	-83.83
Dipole, Da:	6.54
IP(EA), eV:	-8.66(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=CC(=C1)NC(=O)C2CC2)OCC3CC3

DOS

IR

Vibrations