Geometry & MOs

Info

ID:	309576
PubChem CID:	126549261
Reduced:	NOC7H10 (2)
Stoich.:	ABC7D10 (2)
Weight, g/mol:	289.204179
ΔH_f, kcal/mol:	-9.1
Dipole, Da:	10.53
IP(EA), eV:	-8.65(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[(1-methylcyclohexyl)amino]benzoate

Drug info:

PubChemData

Smile

CC1(CCCCC1)N(C)C2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations