Geometry & MOs

Info

ID:	199546
PubChem CID:	79265149
Reduced:	NO4C15H17 (1)
Stoich.:	AB4C15D17 (1)
Weight, g/mol:	295.141973
ΔH_f, kcal/mol:	-113.55
Dipole, Da:	2.5
IP(EA), eV:	-9.06(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[tert-butyl-(2,5-dimethoxybenzoyl)amino]acetic acid

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C=CC(=O)N(CC=C)CC(=O)O

DOS

IR

Vibrations