Geometry & MOs

Info

ID:	77274
PubChem CID:	48426004
Reduced:	N3O5C16H23 (1)
Stoich.:	A3B5C16D23 (1)
Weight, g/mol:	403.133255
ΔH_f, kcal/mol:	-189.78
Dipole, Da:	2.61
IP(EA), eV:	-8.99(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[(3-chlorophenyl)sulfonylamino]-N-[2-(diethylamino)-2-oxoethyl]-3-methylbutanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=CC(=C(C=C1)OCC(=O)N)OC

DOS

IR

Vibrations