Geometry & MOs

Info

ID:	199016
PubChem CID:	79187760
Reduced:	SO2N3C13H29 (1)
Stoich.:	AB2C3D13E29 (1)
Weight, g/mol:	286.146347
ΔH_f, kcal/mol:	-112.03
Dipole, Da:	4.44
IP(EA), eV:	-8.71(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CN(CC1C)S(=O)(=O)N(C)CCCNC(C)C

DOS

IR

Vibrations