Geometry & MOs

Info

ID:	422173
PubChem CID:	135117335
Reduced:	O3N4C17H22 (1)
Stoich.:	A3B4C17D22 (1)
Weight, g/mol:	277.15904
ΔH_f, kcal/mol:	-128.57
Dipole, Da:	6.65
IP(EA), eV:	-8.48(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-fluoro-5-methylphenyl)methyl-[(3-methylimidazol-4-yl)methyl]amino]ethanol

Drug info:

PubChemData

Smile

CC1=CC(=C(N=C1C)N2CCC3(CC2)CC(=O)NC(=O)C3)C(=O)N

DOS

IR

Vibrations