Geometry & MOs

Info

ID:	135160
PubChem CID:	51827009
Reduced:	SN2O6C24H30 (1)
Stoich.:	AB2C6D24E30 (1)
Weight, g/mol:	476.199734
ΔH_f, kcal/mol:	-213.58
Dipole, Da:	1.6
IP(EA), eV:	-8.68(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-N-butyl-2-[tert-butyl-[2-(2,3-dichlorophenyl)acetyl]amino]-3-phenylbutanamide

Drug info:

PubChemData

Smile

C/C=C/[C@H](C(=O)NCS(=O)(=O)C1=CC=C(C=C1)C)N(C(=O)C2=C(C(=CC=C2)O)O)C(C)(C)C

DOS

IR

Vibrations