Geometry & MOs

Info

ID:	36087
PubChem CID:	7980751
Reduced:	NO3H19C21 (1)
Stoich.:	AB3C19D21 (1)
Weight, g/mol:	377.126323
ΔH_f, kcal/mol:	-76.83
Dipole, Da:	4.73
IP(EA), eV:	-8.42(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(4-methoxycarbonylphenyl)methylamino]-2-oxoethyl] naphthalene-2-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)COC(=O)C2=CC3=CC=CC=C3C=C2)C

DOS

IR

Vibrations