Geometry & MOs

Info

ID:	208598
PubChem CID:	80550496
Reduced:	N2C17H34 (1)
Stoich.:	A2B17C34 (1)
Weight, g/mol:	310.182733
ΔH_f, kcal/mol:	-47.0
Dipole, Da:	2.12
IP(EA), eV:	-8.36(2.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-tert-butylthiadiazol-5-yl)-[4-(ethylaminomethyl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CCC1CCCC(CC1)N2CCC(CC2)CNCC

DOS

IR

Vibrations