Geometry & MOs

Info

ID:	79329
PubChem CID:	49748062
Reduced:	NOC12H12 (2)
Stoich.:	ABC12D12 (2)
Weight, g/mol:	418.11627
ΔH_f, kcal/mol:	10.55
Dipole, Da:	3.4
IP(EA), eV:	-8.99(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(furan-2-yl)ethyl]-3,5-difluorobenzenesulfonamide

Drug info:

PubChemData

Smile

C1CN(CC2=CC=CC=C21)C(CNC(=O)/C=C/C3=CC=CC=C3)C4=CC=CO4

DOS

IR

Vibrations