Geometry & MOs

Info

ID:	340424
PubChem CID:	127262435
Reduced:	ClNO2C17H20 (1)
Stoich.:	ABC2D17E20 (1)
Weight, g/mol:	305.118257
ΔH_f, kcal/mol:	-107.01
Dipole, Da:	3.29
IP(EA), eV:	-8.64(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,4,6-trimethylphenyl)methyl 4-aminobenzoate;hydrochloride

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)COC(=O)C2=CC=CC=C2N)C.Cl

DOS

IR

Vibrations