Geometry & MOs

Info

ID:	438811
PubChem CID:	135228568
Reduced:	NC23H29 (1)
Stoich.:	AB23C29 (1)
Weight, g/mol:	293.177964
ΔH_f, kcal/mol:	33.26
Dipole, Da:	1.12
IP(EA), eV:	-9.06(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylidenecyclohexyl)-2-(5H-pyrrolo[2,1-a]isoindol-5-yl)ethanol

Drug info:

PubChemData

Smile

CC=N/C=C(\C)/C1=CC=CC=C1C(C)CC(C)C2=CC=CC(=C2)C

DOS

IR

Vibrations