Geometry & MOs

Info

ID:	358050
PubChem CID:	127295595
Reduced:	S2N3O4C17H21 (1)
Stoich.:	A2B3C4D17E21 (1)
Weight, g/mol:	365.086784
ΔH_f, kcal/mol:	-110.95
Dipole, Da:	3.67
IP(EA), eV:	-9.48(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NC(=CS1)C(C)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCOCC3

DOS

IR

Vibrations