Geometry & MOs

Info

ID:	29908
PubChem CID:	838151
Reduced:	NO4C17H17 (1)
Stoich.:	AB4C17D17 (1)
Weight, g/mol:	314.115424
ΔH_f, kcal/mol:	-141.7
Dipole, Da:	6.61
IP(EA), eV:	-8.7(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-methoxy-4-(3-methylbenzoyl)oxybenzoate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC=CC(=C2)C)O

DOS

IR

Vibrations