Geometry & MOs

Info

ID:	167240
PubChem CID:	74796991
Reduced:	N3O5C22H27 (1)
Stoich.:	A3B5C22D27 (1)
Weight, g/mol:	395.220892
ΔH_f, kcal/mol:	-121.55
Dipole, Da:	5.54
IP(EA), eV:	-8.53(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-cyclopropyl-5-(2,4-dimethylphenyl)pyrazolidin-4-yl]-3,4-dimethoxybenzamide

Drug info:

PubChemData

Smile

CCCC1C(C(NN1)C2=CC3=C(C=C2)OCO3)NC(=O)C4=CC(=C(C=C4)OC)OC

DOS

IR

Vibrations