Geometry & MOs

Info

ID:	348546
PubChem CID:	127273657
Reduced:	SO3N5C18H25 (1)
Stoich.:	AB3C5D18E25 (1)
Weight, g/mol:	327.169525
ΔH_f, kcal/mol:	-88.37
Dipole, Da:	5.91
IP(EA), eV:	-9.48(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]-1-oxopropan-2-yl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)NC2CCC3=NC(=NN3C2)C

DOS

IR

Vibrations