Geometry & MOs

Info

ID:	146653
PubChem CID:	53724698
Reduced:	N2O2C11H14 (1)
Stoich.:	A2B2C11D14 (1)
Weight, g/mol:	296.201439
ΔH_f, kcal/mol:	-56.68
Dipole, Da:	1.85
IP(EA), eV:	-8.89(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

hydroxy-dimethyl-[3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)propyl]azanium

Drug info:

PubChemData

Smile

CC1CN=C(N1)CC2=CC(=C(C=C2)O)O

DOS

IR

Vibrations