Geometry & MOs

Info

ID:	352836
PubChem CID:	127283926
Reduced:	SO3N4C19H26 (1)
Stoich.:	AB3C4D19E26 (1)
Weight, g/mol:	365.177313
ΔH_f, kcal/mol:	-73.15
Dipole, Da:	3.95
IP(EA), eV:	-8.98(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)CN2CCN(CC2)S(=O)(=O)N3CCC4=CC=CC=C4C3)C

DOS

IR

Vibrations