Geometry & MOs

Info

ID:	201356
PubChem CID:	79527394
Reduced:	ON3C15H23 (1)
Stoich.:	AB3C15D23 (1)
Weight, g/mol:	288.150764
ΔH_f, kcal/mol:	-29.27
Dipole, Da:	4.87
IP(EA), eV:	-9.27(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(aminomethyl)-N-(1,1-dioxothiolan-3-yl)-N-methylcyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CC=NC=C1)C(=O)C2CCC(CC2)CN

DOS

IR

Vibrations