Geometry & MOs

Info

ID:	368134
PubChem CID:	127327671
Reduced:	SN2O3C14H18 (1)
Stoich.:	AB2C3D14E18 (1)
Weight, g/mol:	337.146013
ΔH_f, kcal/mol:	-108.96
Dipole, Da:	9.45
IP(EA), eV:	-9.51(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-oxo-N-(2-pyrrolidin-1-ylethyl)-3,4-dihydro-2H-isoquinoline-7-sulfonamide

Drug info:

PubChemData

Smile

CC1CCN(C1)S(=O)(=O)C2=CC3=C(CCNC3=O)C=C2

DOS

IR

Vibrations