Geometry & MOs

Info

ID:	49155
PubChem CID:	11528769
Reduced:	N3H11C15 (1)
Stoich.:	A3B11C15 (1)
Weight, g/mol:	233.141579
ΔH_f, kcal/mol:	125.51
Dipole, Da:	6.97
IP(EA), eV:	-8.96(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(cyclohex-2-en-1-ylamino)-1-hydroxyethyl]phenol

Drug info:

PubChemData

Smile

CN1C=CC=C1/C=C(\C#N)/C2=CC=C(C=C2)C#N

DOS

IR

Vibrations