Geometry & MOs

Info

ID:	180537
PubChem CID:	76649648
Reduced:	O2N3C10H11 (1)
Stoich.:	A2B3C10D11 (1)
Weight, g/mol:	496.1467
ΔH_f, kcal/mol:	-62.17
Dipole, Da:	5.18
IP(EA), eV:	-9.3(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

2-(3-methylcyclohexyl)-1-[4-[5-[3-(2H-thiophen-2-id-5-yl)propyl]cyclopenten-1-yl]phenyl]ethanol;yttrium

Drug info:

PubChemData

Smile

CC1NC(=O)NC(=O)N1C2=CC=CC=C2

DOS

IR

Vibrations