Geometry & MOs

Info

ID:	18278
PubChem CID:	539349
Reduced:	NO4C30H45 (1)
Stoich.:	AB4C30D45 (1)
Weight, g/mol:	483.334859
ΔH_f, kcal/mol:	-230.29
Dipole, Da:	4.35
IP(EA), eV:	-8.71(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,3,7,23-tetramethyl-10-oxo-11-oxa-9-azahexacyclo[12.12.0.02,12.04,9.015,24.018,23]hexacos-4-en-20-yl) acetate

Drug info:

PubChemData

Smile

CC1CC=C2C(C3C(CC4C3(CCC5C4CCC6C5(CCC(C6)OC(=O)C)C)C)OC(=O)N2C1)C

DOS

IR

Vibrations