Geometry & MOs

Info

ID:	198793
PubChem CID:	79151933
Reduced:	BrON2C15H21 (1)
Stoich.:	ABC2D15E21 (1)
Weight, g/mol:	270.194343
ΔH_f, kcal/mol:	-31.08
Dipole, Da:	2.88
IP(EA), eV:	-9.1(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=C1Br)C(=O)N2CCCCCC2

DOS

IR

Vibrations