Geometry & MOs

Info

ID:	135248
PubChem CID:	51839777
Reduced:	N2O3C20H30 (1)
Stoich.:	A2B3C20D30 (1)
Weight, g/mol:	488.117271
ΔH_f, kcal/mol:	-120.08
Dipole, Da:	6.24
IP(EA), eV:	-9.09(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[(2-chloroacetyl)-[(5-methylfuran-2-yl)methyl]amino]-N-[(4-methylphenyl)sulfonylmethyl]-2-phenylacetamide

Drug info:

PubChemData

Smile

CCCCNC(=O)[C@@H](/C=C/C)N(CC1=CC=C(O1)C)C(=O)C=C(C)C

DOS

IR

Vibrations