Geometry & MOs

Info

ID:	121296
PubChem CID:	50762083
Reduced:	N3O3C19H19 (1)
Stoich.:	A3B3C19D19 (1)
Weight, g/mol:	315.158292
ΔH_f, kcal/mol:	-72.49
Dipole, Da:	4.65
IP(EA), eV:	-8.67(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-3-[4-(ethylamino)-2-oxochromen-3-yl]urea

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)NC2=C(C3=CC=CC=C3OC2=O)NC)C

DOS

IR

Vibrations