Geometry & MOs

Info

ID:	447168
PubChem CID:	135280893
Reduced:	N4O14C27H56 (1)
Stoich.:	A4B14C27D56 (1)
Weight, g/mol:	250.153741
ΔH_f, kcal/mol:	-657.43
Dipole, Da:	2.51
IP(EA), eV:	-9.45(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-[methyl(propan-2-yl)amino]ethyldisulfanyl]ethyl]propan-2-amine

Drug info:

PubChemData

Smile

C(COCC(COCCC(=O)NC(CO)CO)(COCCNC(CO)CO)COCCNC(CO)CO)C(=O)NC(CO)CO

DOS

IR

Vibrations