Geometry & MOs

Info

ID:	69457
PubChem CID:	47180334
Reduced:	SO3N4H8C11 (1)
Stoich.:	AB3C4D8E11 (1)
Weight, g/mol:	298.119654
ΔH_f, kcal/mol:	-27.53
Dipole, Da:	4.3
IP(EA), eV:	-8.69(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-[(5-chloropyridin-2-yl)-methylamino]acetyl]amino]-N-propan-2-ylacetamide

Drug info:

PubChemData

Smile

C1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C3=CSN=N3

DOS

IR

Vibrations