Geometry & MOs

Info

ID:	46000
PubChem CID:	10520250
Reduced:	NO4C19H21 (1)
Stoich.:	AB4C19D21 (1)
Weight, g/mol:	327.147058
ΔH_f, kcal/mol:	-124.19
Dipole, Da:	8.05
IP(EA), eV:	-9.07(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (3R)-3-phenyl-3-(phenylmethoxycarbonylamino)propanoate

Drug info:

PubChemData

Smile

CC[C@@H](COCC1=CC=CC2=CC=CC=C21)NC(=O)/C=C\C(=O)O

DOS

IR

Vibrations