Geometry & MOs

Info

ID:	215963
PubChem CID:	85085514
Reduced:	NO2C12H15 (1)
Stoich.:	AB2C12D15 (1)
Weight, g/mol:	206.00841
ΔH_f, kcal/mol:	-77.42
Dipole, Da:	4.93
IP(EA), eV:	-9.62(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1C2=CC=CC=C2CNC1(C)C(=O)O

DOS

IR

Vibrations