Geometry & MOs

Info

ID:	367262
PubChem CID:	127324039
Reduced:	FSO2N3C21H22 (1)
Stoich.:	ABC2D3E21F22 (1)
Weight, g/mol:	353.221561
ΔH_f, kcal/mol:	-91.88
Dipole, Da:	2.31
IP(EA), eV:	-8.62(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)urea

Drug info:

PubChemData

Smile

C1CSC2=C(C1NC(=O)N3CCNC(=O)CC3C4=CC=CC=C4)C=CC=C2F

DOS

IR

Vibrations