Geometry & MOs

Info

ID:	205554
PubChem CID:	80120377
Reduced:	NO3C17H19 (1)
Stoich.:	AB3C17D19 (1)
Weight, g/mol:	287.115758
ΔH_f, kcal/mol:	-95.84
Dipole, Da:	2.6
IP(EA), eV:	-8.42(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-5-[(3-methoxyphenyl)methoxy]-3-methylbenzoic acid

Drug info:

PubChemData

Smile

CCC1=CC(=CC=C1)OC2=CC(=C(C(=C2)C)N)C(=O)OC

DOS

IR

Vibrations