Geometry & MOs

Info

ID:	327840
PubChem CID:	126691143
Reduced:	OC14H20 (1)
Stoich.:	AB14C20 (1)
Weight, g/mol:	392.246378
ΔH_f, kcal/mol:	-31.31
Dipole, Da:	1.63
IP(EA), eV:	-8.18(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(3R)-1-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)piperidin-3-yl]carbamate

Drug info:

PubChemData

Smile

CCC1=CC(=C(C(=C1)C=CC)OC)CC

DOS

IR

Vibrations