Geometry & MOs

Info

ID:	202485
PubChem CID:	79679344
Reduced:	SO5C14H18 (1)
Stoich.:	AB5C14D18 (1)
Weight, g/mol:	180.137497
ΔH_f, kcal/mol:	-203.33
Dipole, Da:	6.02
IP(EA), eV:	-9.89(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-(pyrrolidin-1-ylmethyl)pyrazol-3-amine

Drug info:

PubChemData

Smile

CC1CCCC1(C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OC

DOS

IR

Vibrations