Geometry & MOs

Info

ID:	195723
PubChem CID:	78728186
Reduced:	N2O6H20C21 (1)
Stoich.:	A2B6C20D21 (1)
Weight, g/mol:	419.149951
ΔH_f, kcal/mol:	-180.67
Dipole, Da:	8.01
IP(EA), eV:	-8.63(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2,5-dimethylanilino)-1-oxopropan-2-yl] 3-chloro-5-methoxy-4-propan-2-yloxybenzoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)NC(=O)C(C)OC(=O)CN2C3=CC=CC=C3C(=O)C2=O

DOS

IR

Vibrations