Geometry & MOs

Info

ID:	183513
PubChem CID:	77033340
Reduced:	ClSO2N3C11H16 (1)
Stoich.:	ABC2D3E11F16 (1)
Weight, g/mol:	310.029125
ΔH_f, kcal/mol:	-38.35
Dipole, Da:	2.91
IP(EA), eV:	-9.32(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-chlorothiophen-2-yl)methyl]-5-(N'-hydroxycarbamimidoyl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C(=NO)N)C(=O)NCC1=CC=C(S1)Cl

DOS

IR

Vibrations