Geometry & MOs

Info

ID:	11233
PubChem CID:	112189
Reduced:	SN3O4C23H29 (1)
Stoich.:	AB3C4D23E29 (1)
Weight, g/mol:	443.187878
ΔH_f, kcal/mol:	-108.66
Dipole, Da:	6.21
IP(EA), eV:	-8.23(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[1-(2-hydroxyethyl)-2,7-dimethyl-3,4-dihydro-2H-quinolin-6-yl]diazenyl]-5-(2-methylpropanoyl)thiophene-3-carboxylate

Drug info:

PubChemData

Smile

CC1CCC2=C(N1CCO)C=C(C(=C2)N=NC3=C(C=C(S3)C(=O)C(C)C)C(=O)OC)C

DOS

IR

Vibrations