Geometry & MOs

Info

ID:	128114
PubChem CID:	51031841
Reduced:	NO2H11C16 (1)
Stoich.:	AB2C11D16 (1)
Weight, g/mol:	281.141579
ΔH_f, kcal/mol:	49.13
Dipole, Da:	2.19
IP(EA), eV:	-9.9(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (Z)-3-phenyl-3-[[(1R)-1-phenylethyl]amino]prop-2-enoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@H]2[C@](O2)(C#N)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations