Geometry & MOs

Info

ID:	369727
PubChem CID:	127335157
Reduced:	OSN7C16H23 (1)
Stoich.:	ABC7D16E23 (1)
Weight, g/mol:	350.210661
ΔH_f, kcal/mol:	35.49
Dipole, Da:	6.98
IP(EA), eV:	-8.42(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)C(C)SC3=NN=CN3C

DOS

IR

Vibrations