Geometry & MOs

Info

ID:	343683
PubChem CID:	127266859
Reduced:	O2N4C17H32 (1)
Stoich.:	A2B4C17D32 (1)
Weight, g/mol:	332.130697
ΔH_f, kcal/mol:	-119.85
Dipole, Da:	3.56
IP(EA), eV:	-9.01(1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-3,6-dihydro-2H-pyridin-5-yl]pyridine

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)NCC2CCN(CC2)CC(=O)N(C)C

DOS

IR

Vibrations