Geometry & MOs

Info

ID:	52283
PubChem CID:	12015101
Reduced:	NO6C19H21 (1)
Stoich.:	AB6C19D21 (1)
Weight, g/mol:	210.089209
ΔH_f, kcal/mol:	-210.19
Dipole, Da:	12.24
IP(EA), eV:	-7.8(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2,2-dimethoxyacetate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NC(=C(C1=C2C=CC(=O)C(=C2)O)C(=O)OCC)C)C

DOS

IR

Vibrations