Geometry & MOs

Info

ID:	201355
PubChem CID:	79527393
Reduced:	N2O2C15H28 (1)
Stoich.:	A2B2C15D28 (1)
Weight, g/mol:	261.184112
ΔH_f, kcal/mol:	-99.48
Dipole, Da:	5.03
IP(EA), eV:	-9.28(1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(aminomethyl)-N-methyl-N-(pyridin-4-ylmethyl)cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(CCC1CN)C(=O)NCCCOCC2CC2

DOS

IR

Vibrations