Geometry & MOs

Info

ID:	195859
PubChem CID:	78743207
Reduced:	NO5C19H25 (1)
Stoich.:	AB5C19D25 (1)
Weight, g/mol:	417.097915
ΔH_f, kcal/mol:	-195.04
Dipole, Da:	1.59
IP(EA), eV:	-9.66(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-ethoxycarbonylanilino)-2-oxoethyl] 6-chloro-3,4-dihydro-2H-chromene-3-carboxylate

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)OC)NC(=O)COC(=O)C1(CC1)C2=CC=CC=C2

DOS

IR

Vibrations