Geometry & MOs

Info

ID:	196583
PubChem CID:	78850606
Reduced:	FN2O3C18H25 (1)
Stoich.:	AB2C3D18E25 (1)
Weight, g/mol:	425.107709
ΔH_f, kcal/mol:	-175.62
Dipole, Da:	6.07
IP(EA), eV:	-9.09(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-[(4-chlorophenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]-5-methylimidazo[1,2-a]pyridine

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)CN1CCCN(CC1)C(=O)C2=CC(=CC=C2)F

DOS

IR

Vibrations