Geometry & MOs

Info

ID:	287756
PubChem CID:	104293904
Reduced:	ON3C16H31 (1)
Stoich.:	AB3C16D31 (1)
Weight, g/mol:	268.215078
ΔH_f, kcal/mol:	-82.97
Dipole, Da:	4.66
IP(EA), eV:	-8.41(1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N,5-dimethyl-N-(oxan-3-ylmethyl)cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CC1CC(CC(C1)N)C(=O)N(C)CC2CCN(CC2)C

DOS

IR

Vibrations