Geometry & MOs

Info

ID:	348325
PubChem CID:	127273390
Reduced:	SO2N5C19H23 (1)
Stoich.:	AB2C5D19E23 (1)
Weight, g/mol:	369.18009
ΔH_f, kcal/mol:	-29.81
Dipole, Da:	5.78
IP(EA), eV:	-8.32(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)carbamoyl]phenyl]oxolane-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)C3CC(=O)N(C3)C4=CC=C(C=C4)SC

DOS

IR

Vibrations