Geometry & MOs

Info

ID:	417683
PubChem CID:	135102492
Reduced:	N5C23H29 (1)
Stoich.:	A5B23C29 (1)
Weight, g/mol:	395.106846
ΔH_f, kcal/mol:	69.45
Dipole, Da:	0.76
IP(EA), eV:	-8.18(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-N-[(2-methyl-1H-imidazol-5-yl)methyl]-3,5-bis(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

CN1C=CC2=C1C=CC(=C2)CN3CCCC4(C3)CCC5=CN=C(N=C45)N(C)C

DOS

IR

Vibrations