Geometry & MOs

Info

ID:	237978
PubChem CID:	92723378
Reduced:	SN2O4C15H20 (1)
Stoich.:	AB2C4D15E20 (1)
Weight, g/mol:	367.156577
ΔH_f, kcal/mol:	-155.53
Dipole, Da:	5.3
IP(EA), eV:	-9.43(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-butan-2-yl]-2-[methyl-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]amino]acetamide

Drug info:

PubChemData

Smile

C1C[C@H](OC1)CNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CCC3

DOS

IR

Vibrations