Geometry & MOs

Info

ID:	13612
PubChem CID:	395964
Reduced:	NOH9C10 (2)
Stoich.:	ABC9D10 (2)
Weight, g/mol:	318.136828
ΔH_f, kcal/mol:	1.77
Dipole, Da:	3.78
IP(EA), eV:	-8.44(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-imino-N-(4-methylphenyl)-8-prop-2-enylchromene-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)C2=CC3=C(C(=CC=C3)CC=C)OC2=N

DOS

IR

Vibrations