Geometry & MOs

Info

ID:	370271
PubChem CID:	127337938
Reduced:	O2N5C19H31 (1)
Stoich.:	A2B5C19D31 (1)
Weight, g/mol:	333.216475
ΔH_f, kcal/mol:	-68.54
Dipole, Da:	6.43
IP(EA), eV:	-8.4(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-N-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)N(C)C3CCC(CC3)OC

DOS

IR

Vibrations