Geometry & MOs

Info

ID:	121115
PubChem CID:	50756408
Reduced:	N3O5C27H33 (1)
Stoich.:	A3B5C27D33 (1)
Weight, g/mol:	405.205242
ΔH_f, kcal/mol:	-140.19
Dipole, Da:	7.95
IP(EA), eV:	-7.97(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-11-methyl-10-(2-methylphenyl)-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(CN2C3=C(C=C2C(=O)N1CCC4=C(C=CC(=C4)OC)OC)OC=C3)C(=O)NC5CCCCC5

DOS

IR

Vibrations