Geometry & MOs

Info

ID:	183567
PubChem CID:	77041575
Reduced:	OSN3C12H19 (1)
Stoich.:	ABC3D12E19 (1)
Weight, g/mol:	254.093439
ΔH_f, kcal/mol:	16.75
Dipole, Da:	0.65
IP(EA), eV:	-8.79(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-amino-4-chlorophenyl)-3-methylpyrazolidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)CCC2=CSC=C2)C(=NO)N

DOS

IR

Vibrations