Geometry & MOs

Info

ID:	83859
PubChem CID:	49861910
Reduced:	N3C19H35 (1)
Stoich.:	A3B19C35 (1)
Weight, g/mol:	445.366828
ΔH_f, kcal/mol:	-34.78
Dipole, Da:	1.18
IP(EA), eV:	-8.29(2.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

18-cyclohexyl-8-[2-(dimethylamino)ethyl]-8,11-diazatetracyclo[9.7.0.02,7.012,17]octadecane-14-carboxylic acid

Drug info:

PubChemData

Smile

CN1CCC2(CC1)CN(C3C2CCCC3)C4CCCCC4N

DOS

IR

Vibrations