Geometry & MOs

Info

ID:	76181
PubChem CID:	48424556
Reduced:	SN4O4C18H24 (1)
Stoich.:	AB4C4D18E24 (1)
Weight, g/mol:	352.145678
ΔH_f, kcal/mol:	-97.84
Dipole, Da:	4.63
IP(EA), eV:	-9.16(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-(cyclopropylmethoxy)propanoyl]-3,4-dihydro-1H-isoquinolin-5-yl]methanesulfonamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CNC3=C2C=CC=N3)OCC4CC4

DOS

IR

Vibrations