Geometry & MOs

Info

ID:	85627
PubChem CID:	49877764
Reduced:	ClON4C27H27 (1)
Stoich.:	ABC4D27E27 (1)
Weight, g/mol:	366.157957
ΔH_f, kcal/mol:	28.01
Dipole, Da:	4.58
IP(EA), eV:	-8.2(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-2-oxochromene-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C2=C(N1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)Cl)C(C4=CC=CC=N4)N5CCCCC5

DOS

IR

Vibrations