Geometry & MOs

Info

ID:	4048
PubChem CID:	10641
Reduced:	NC20H23 (1)
Stoich.:	AB20C23 (1)
Weight, g/mol:	277.18305
ΔH_f, kcal/mol:	50.89
Dipole, Da:	2.02
IP(EA), eV:	-8.62(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyl)propan-1-amine

Drug info:

PubChemData

Smile

CN(C)CCCC1C2=CC=CC=C2C=CC3=CC=CC=C13

DOS

IR

Vibrations