Geometry & MOs

Info

ID:	183381
PubChem CID:	77014899
Reduced:	ON3C15H23 (1)
Stoich.:	AB3C15D23 (1)
Weight, g/mol:	267.150225
ΔH_f, kcal/mol:	-14.87
Dipole, Da:	10.03
IP(EA), eV:	-8.98(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-chlorophenyl)-5-(3-methylbutan-2-yl)pyrazolidin-3-amine

Drug info:

PubChemData

Smile

CCC(CC1CC1)NC(=C2C(=NC(=NC2=O)C)C)C

DOS

IR

Vibrations