Geometry & MOs

Info

ID:	181521
PubChem CID:	76755899
Reduced:	NO2C14H22 (2)
Stoich.:	AB2C14D22 (2)
Weight, g/mol:	445.319209
ΔH_f, kcal/mol:	-120.82
Dipole, Da:	2.41
IP(EA), eV:	-9.46(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3,4,4,19,19-pentamethyl-2,16-dioxo-1-azatricyclo[15.4.0.018,20]henicos-8-ene-14-carboxylate

Drug info:

PubChemData

Smile

CC1(C2C1C3C(=O)CC(CCCCCCCCCC(C(=O)N3C2)N)C(=O)C(=O)CCC4CC4)C

DOS

IR

Vibrations