Geometry & MOs

Info

ID:	236992
PubChem CID:	92716649
Reduced:	O3N4C24H26 (1)
Stoich.:	A3B4C24D26 (1)
Weight, g/mol:	383.209658
ΔH_f, kcal/mol:	-44.67
Dipole, Da:	5.23
IP(EA), eV:	-8.61(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7S)-7-ethyl-1,7-dimethyl-N-[(1R,2S)-2-methylcyclohexyl]-9-oxo-8H-furo[3,2-f]chromene-2-carboxamide

Drug info:

PubChemData

Smile

CC[C@H](C(=O)NC1=CC=CC=C1OCC)N2C(=O)C3=CC4=C(N3C(=N2)C)C=CC(=C4)C

DOS

IR

Vibrations