Geometry & MOs

Info

ID:	158816
PubChem CID:	56479384
Reduced:	SN3O4C23H27 (1)
Stoich.:	AB3C4D23E27 (1)
Weight, g/mol:	407.10704
ΔH_f, kcal/mol:	-85.11
Dipole, Da:	7.68
IP(EA), eV:	-9.36(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[3-(1-methyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl)-3-oxopropyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=NO1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

DOS

IR

Vibrations