Geometry & MOs

Info

ID:	237777
PubChem CID:	92721420
Reduced:	N3O4C22H31 (1)
Stoich.:	A3B4C22D31 (1)
Weight, g/mol:	429.262757
ΔH_f, kcal/mol:	-128.39
Dipole, Da:	5.34
IP(EA), eV:	-8.87(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(11S)-N-cycloheptyl-11-methyl-9-oxo-10-(3-propan-2-yloxypropyl)-5-oxa-1,10-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7-triene-11-carboxamide

Drug info:

PubChemData

Smile

C[C@@]1(CN2C3=C(C=C2C(=O)N1CCCOC)OC=C3)C(=O)NC4CCCCCC4

DOS

IR

Vibrations