Geometry & MOs

Info

ID:	391045
PubChem CID:	135002456
Reduced:	NO2C16H21 (1)
Stoich.:	AB2C16D21 (1)
Weight, g/mol:	349.167794
ΔH_f, kcal/mol:	-58.68
Dipole, Da:	5.14
IP(EA), eV:	-9.49(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (3R)-3-(2-methoxyanilino)-3-naphthalen-2-ylpropanoate

Drug info:

PubChemData

Smile

CC1(CCC2N1OC(=O)C2CCC3=CC=CC=C3)C

DOS

IR

Vibrations