Geometry & MOs

Info

ID:	280828
PubChem CID:	103851509
Reduced:	ClFN2C14H20 (1)
Stoich.:	ABC2D14E20 (1)
Weight, g/mol:	289.179027
ΔH_f, kcal/mol:	-17.86
Dipole, Da:	4.34
IP(EA), eV:	-8.91(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[(2-cyanophenyl)methylamino]ethyl]-N-methylcarbamate

Drug info:

PubChemData

Smile

CCN(CCNCC1=CC(=C(C=C1)F)Cl)C2CC2

DOS

IR

Vibrations