Geometry & MOs

Info

ID:	121113
PubChem CID:	50756383
Reduced:	FSO2N4C24H25 (1)
Stoich.:	ABC2D4E24F25 (1)
Weight, g/mol:	479.242021
ΔH_f, kcal/mol:	-58.13
Dipole, Da:	10.39
IP(EA), eV:	-9.05(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-10-[2-(2,4-dimethoxyphenyl)ethyl]-11-methyl-9-oxo-5-oxa-1,10-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7-triene-11-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CNC(=O)CSC2=NC(=O)C3=C(N2)CCN(C3)CC4=CC=C(C=C4)F

DOS

IR

Vibrations