Geometry & MOs

Info

ID:	1614
PubChem CID:	4773
Reduced:	ON3C17H21 (1)
Stoich.:	AB3C17D21 (1)
Weight, g/mol:	283.168462
ΔH_f, kcal/mol:	15.01
Dipole, Da:	4.81
IP(EA), eV:	-8.19(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4,5-dihydro-1H-imidazol-2-ylmethyl-(4-methylcyclohexa-1,3-dien-1-yl)amino]phenol

Drug info:

PubChemData

Smile

CC1=CC=C(CC1)N(CC2=NCCN2)C3=CC(=CC=C3)O

DOS

IR

Vibrations