Geometry & MOs

Info

ID:	149143
PubChem CID:	53788815
Reduced:	SN2O4C16H26 (1)
Stoich.:	AB2C4D16E26 (1)
Weight, g/mol:	162.115698
ΔH_f, kcal/mol:	-191.12
Dipole, Da:	2.09
IP(EA), eV:	-9.8(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6,7,8-tetrahydronaphthalene-1,4-diamine

Drug info:

PubChemData

Smile

CCCC(CC1=NC(=CS1)C(=O)OCC)NC(=O)OC(C)(C)C

DOS

IR

Vibrations