Geometry & MOs

Info

ID:	364088
PubChem CID:	127313877
Reduced:	SN3O4C14H27 (1)
Stoich.:	AB3C4D14E27 (1)
Weight, g/mol:	225.209264
ΔH_f, kcal/mol:	-172.77
Dipole, Da:	3.64
IP(EA), eV:	-8.83(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,2-dimethyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine

Drug info:

PubChemData

Smile

C1COCCC1CN2CCN(CC2)S(=O)(=O)N3CCOCC3

DOS

IR

Vibrations