Geometry & MOs

Info

ID:	74028
PubChem CID:	48421371
Reduced:	ON3C7H10 (2)
Stoich.:	AB3C7D10 (2)
Weight, g/mol:	290.149124
ΔH_f, kcal/mol:	-9.54
Dipole, Da:	10.43
IP(EA), eV:	-9.17(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-1-(2-hydroxypropyl)-3-[6-(1,2,4-triazol-1-yl)pyridin-3-yl]urea

Drug info:

PubChemData

Smile

CCN(CC(C)O)C(=O)NC1=C(C=CC(=C1)N2C=NN=N2)C

DOS

IR

Vibrations