Geometry & MOs

Info

ID:	348969
PubChem CID:	127274695
Reduced:	SN3O3C17H27 (1)
Stoich.:	AB3C3D17E27 (1)
Weight, g/mol:	386.231791
ΔH_f, kcal/mol:	-90.32
Dipole, Da:	4.41
IP(EA), eV:	-8.92(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-methyl-1-oxo-1-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]butan-2-yl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)CN2CCN(CC2)C(=O)CSCC3CCCCO3

DOS

IR

Vibrations