Geometry & MOs

Info

ID:	146209
PubChem CID:	53651091
Reduced:	IN4H23C32 (1)
Stoich.:	AB4C23D32 (1)
Weight, g/mol:	272.17763
ΔH_f, kcal/mol:	230.63
Dipole, Da:	4.0
IP(EA), eV:	-7.94(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyclohexen-1-yl)-2-cyclopentyloxy-1-methoxybenzene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C3C=CC(=CC4=CC=C(N4)C(=C5C=CC(=C(C6=CC=C2N6)I)N5)C7=CC=CC=C7)N3

DOS

IR

Vibrations