Geometry & MOs

Info

ID:	315244
PubChem CID:	126625256
Reduced:	IO2N4C6H11 (1)
Stoich.:	AB2C4D6E11 (1)
Weight, g/mol:	244.251464
ΔH_f, kcal/mol:	-0.66
Dipole, Da:	4.75
IP(EA), eV:	-9.92(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(5-amino-3-methylhexan-3-yl)oxy-3-methylhexan-3-amine

Drug info:

PubChemData

Smile

C(CNC(=O)COCI)CN=[N+]=[N-]

DOS

IR

Vibrations