Geometry & MOs

Info

ID:	135043
PubChem CID:	51803130
Reduced:	SN2O5C26H34 (1)
Stoich.:	AB2C5D26E34 (1)
Weight, g/mol:	424.272593
ΔH_f, kcal/mol:	-173.61
Dipole, Da:	5.57
IP(EA), eV:	-8.86(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3R)-N-tert-butyl-2-[[(2S)-2-methoxy-2-phenylacetyl]-propylamino]-3-phenylbutanamide

Drug info:

PubChemData

Smile

CCC/C=C/[C@@H](C(=O)NCS(=O)(=O)C1=CC=C(C=C1)C)N(CCC)C(=O)C2=CC=CC=C2OC

DOS

IR

Vibrations