Geometry & MOs

Info

ID:	422595
PubChem CID:	135118105
Reduced:	O2N5C23H31 (1)
Stoich.:	A2B5C23D31 (1)
Weight, g/mol:	299.124547
ΔH_f, kcal/mol:	-44.15
Dipole, Da:	4.77
IP(EA), eV:	-8.56(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1H-imidazol-2-ylmethyl-[[3-(trifluoromethyl)phenyl]methyl]amino]ethanol

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=C1)C(=O)C2CCN(CC2)C3=NC=CC(=N3)N4CCCC(C4)O

DOS

IR

Vibrations