Geometry & MOs

Info

ID:	32154
PubChem CID:	4266412
Reduced:	O4N7C26H37 (1)
Stoich.:	A4B7C26D37 (1)
Weight, g/mol:	282.125594
ΔH_f, kcal/mol:	-55.97
Dipole, Da:	4.11
IP(EA), eV:	-9.36(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butoxy-4-methylbenzo[c]chromen-6-one

Drug info:

PubChemData

Smile

CCCCCCCCCCCCN1C2=C(N=C1NN=C(C)C3=CC(=CC=C3)[N+](=O)[O-])N(C(=O)NC2=O)C

DOS

IR

Vibrations