Geometry & MOs

Info

ID:	422087
PubChem CID:	135117169
Reduced:	N3O4C18H23 (1)
Stoich.:	A3B4C18D23 (1)
Weight, g/mol:	309.15896
ΔH_f, kcal/mol:	-96.69
Dipole, Da:	3.71
IP(EA), eV:	-9.27(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-5-[(4-pyridin-2-yl-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methyl]-1,2-oxazole

Drug info:

PubChemData

Smile

C1COCCN1C2=NOC(=C2C(=O)NCCCCO)C3=CC=CC=C3

DOS

IR

Vibrations