Geometry & MOs

Info

ID:	170923
PubChem CID:	75302069
Reduced:	OC3H4 (5)
Stoich.:	AB3C4 (5)
Weight, g/mol:	290.247047
ΔH_f, kcal/mol:	-189.85
Dipole, Da:	5.57
IP(EA), eV:	-9.16(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,18,18-trimethyl-3,7,8,13-tetrazapentacyclo[13.2.1.02,14.04,12.06,10]octadecane

Drug info:

PubChemData

Smile

CC(CCO)OC(=O)C1=C(C=C(C=C1OC)OC)C=C

DOS

IR

Vibrations