Geometry & MOs

Info

ID:	24422
PubChem CID:	610063
Reduced:	NO2C12H17 (1)
Stoich.:	AB2C12D17 (1)
Weight, g/mol:	207.125929
ΔH_f, kcal/mol:	-84.67
Dipole, Da:	1.3
IP(EA), eV:	-8.37(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl 2-(methylamino)benzoate

Drug info:

PubChemData

Smile

CCCCOC(=O)C1=CC=CC=C1NC

DOS

IR

Vibrations