Geometry & MOs

Info

ID:	348973
PubChem CID:	127274699
Reduced:	SN4O4C18H30 (1)
Stoich.:	AB4C4D18E30 (1)
Weight, g/mol:	344.221226
ΔH_f, kcal/mol:	-174.24
Dipole, Da:	1.85
IP(EA), eV:	-9.31(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(1-cyclopropylpiperidin-4-yl)amino]-3-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CCCC(=O)N1CSCC1C(=O)N2CCN(CC2)C(=O)CN3CCOCC3

DOS

IR

Vibrations