Geometry & MOs

Info

ID:	350150
PubChem CID:	127277228
Reduced:	SN2O4C18H20 (1)
Stoich.:	AB2C4D18E20 (1)
Weight, g/mol:	385.146013
ΔH_f, kcal/mol:	-95.08
Dipole, Da:	5.3
IP(EA), eV:	-8.29(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-3-[(1-methyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl)sulfonyl]benzamide

Drug info:

PubChemData

Smile

CN1CCN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC4=C3OCCO4

DOS

IR

Vibrations