Geometry & MOs

Info

ID:	378181
PubChem CID:	134224257
Reduced:	NC13H23 (1)
Stoich.:	AB13C23 (1)
Weight, g/mol:	388.334131
ΔH_f, kcal/mol:	-5.38
Dipole, Da:	2.26
IP(EA), eV:	-8.16(0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[10-(4-hydroxycyclohexyl)-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroanthracen-9-yl]cyclohexan-1-ol

Drug info:

PubChemData

Smile

CC(C)CC/C(=C(\C)/C(=C)NC=C)/C

DOS

IR

Vibrations