Geometry & MOs

Info

ID:	183808
PubChem CID:	77072650
Reduced:	N3O5C11H17 (1)
Stoich.:	A3B5C11D17 (1)
Weight, g/mol:	322.075202
ΔH_f, kcal/mol:	-231.04
Dipole, Da:	6.27
IP(EA), eV:	-9.99(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,4-dichlorophenyl)-5-(5-methylpyridin-3-yl)pyrazolidin-3-amine

Drug info:

PubChemData

Smile

CC1CN(C(=O)NC1=O)CC(C(=O)OC)NC(=O)C

DOS

IR

Vibrations