Geometry & MOs

Info

ID:	185693
PubChem CID:	77334215
Reduced:	N2O3C9H16 (1)
Stoich.:	A2B3C9D16 (1)
Weight, g/mol:	386.24571
ΔH_f, kcal/mol:	-127.81
Dipole, Da:	6.24
IP(EA), eV:	-9.84(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-acetyl-5-methyl-16-oxo-6-pentacyclo[13.3.1.02,10.05,9.012,18]nonadecanyl) acetate

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CN1CC(C1=O)N

DOS

IR

Vibrations