Geometry & MOs

Info

ID:	147987
PubChem CID:	53787649
Reduced:	NSO5C19H35 (1)
Stoich.:	ABC5D19E35 (1)
Weight, g/mol:	328.016262
ΔH_f, kcal/mol:	-273.54
Dipole, Da:	3.53
IP(EA), eV:	-8.99(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5,6-trithiophen-2-yl-3,4-dihydropyridazine

Drug info:

PubChemData

Smile

CC1CCC(C1)NC2CC(C(C2)(C)C)S[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)O

DOS

IR

Vibrations