Geometry & MOs

Info

ID:	138187
PubChem CID:	52326280
Reduced:	FN2O3C23H29 (1)
Stoich.:	AB2C3D23E29 (1)
Weight, g/mol:	407.095807
ΔH_f, kcal/mol:	-142.84
Dipole, Da:	7.44
IP(EA), eV:	-8.8(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl (3R)-3-(2-chlorophenyl)-3-[(4-oxo-4-thiophen-2-ylbutanoyl)amino]propanoate

Drug info:

PubChemData

Smile

CC(C)[C@H](C1=CC2=C(C=C1)OCCCO2)NCC(=O)NCCC3=CC=C(C=C3)F

DOS

IR

Vibrations