Geometry & MOs

Info

ID:	433545
PubChem CID:	135173685
Reduced:	ClNOSH8C9 (1)
Stoich.:	ABCDE8F9 (1)
Weight, g/mol:	285.303165
ΔH_f, kcal/mol:	10.37
Dipole, Da:	5.42
IP(EA), eV:	-9.08(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,3-dimethyl-1-(2,3,3,5,5-pentamethylhexan-2-yloxy)pentan-3-amine

Drug info:

PubChemData

Smile

CSOCC1=CC(=C(C=C1)C#N)Cl

DOS

IR

Vibrations