Geometry & MOs

Info

ID:	68223
PubChem CID:	46507996
Reduced:	N3O3C23H27 (1)
Stoich.:	A3B3C23D27 (1)
Weight, g/mol:	362.066949
ΔH_f, kcal/mol:	-104.59
Dipole, Da:	2.44
IP(EA), eV:	-8.82(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)methyl 6-chloro-2H-chromene-3-carboxylate

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1NC(=O)CN2C(=O)C(NC2=O)(C)C3=CC=C(C=C3)C(C)C

DOS

IR

Vibrations