Geometry & MOs

Info

ID:	74956
PubChem CID:	48422755
Reduced:	O3N4C15H18 (1)
Stoich.:	A3B4C15D18 (1)
Weight, g/mol:	389.187005
ΔH_f, kcal/mol:	-66.06
Dipole, Da:	5.04
IP(EA), eV:	-9.02(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]methyl]-2-(cyclopropylmethoxy)-N-methylpropanamide

Drug info:

PubChemData

Smile

CN1C=CC(=N1)NC(=O)C(CC2=CC=CC=C2)NC(=O)OC

DOS

IR

Vibrations