Geometry & MOs

Info

ID:	370262
PubChem CID:	127337929
Reduced:	O2N5C22H29 (1)
Stoich.:	A2B5C22D29 (1)
Weight, g/mol:	371.177982
ΔH_f, kcal/mol:	-28.76
Dipole, Da:	5.55
IP(EA), eV:	-8.53(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)N3CCCC3C4=CC(=CC=C4)OC

DOS

IR

Vibrations