Geometry & MOs

Info

ID:	264846
PubChem CID:	103497597
Reduced:	N2C17H34 (1)
Stoich.:	A2B17C34 (1)
Weight, g/mol:	307.124215
ΔH_f, kcal/mol:	-49.11
Dipole, Da:	2.39
IP(EA), eV:	-8.39(2.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-cyclopropyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2,3-dimethyl-4-oxobutanoic acid

Drug info:

PubChemData

Smile

CCCC1(CCNCC1)CN2CCC(CC2)C(C)C

DOS

IR

Vibrations