Geometry & MOs

Info

ID:	199000
PubChem CID:	79186912
Reduced:	SO2N4C13H24 (1)
Stoich.:	AB2C4D13E24 (1)
Weight, g/mol:	272.130697
ΔH_f, kcal/mol:	-59.46
Dipole, Da:	7.88
IP(EA), eV:	-9.37(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(3,4-dimethylpyrrolidin-1-yl)sulfonyl-5-methyl-1H-pyrazol-3-yl]methanamine

Drug info:

PubChemData

Smile

CCNCCN1C=C(C=N1)S(=O)(=O)N2CC(C(C2)C)C

DOS

IR

Vibrations