Geometry & MOs

Info

ID:	207643
PubChem CID:	80432491
Reduced:	ON3C17H23 (1)
Stoich.:	AB3C17D23 (1)
Weight, g/mol:	306.115047
ΔH_f, kcal/mol:	-20.84
Dipole, Da:	2.57
IP(EA), eV:	-8.8(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)-1H-pyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CCC(CCC(=O)NC1=CC=CC2=C1C=NC=C2)CCN

DOS

IR

Vibrations