Geometry & MOs

Info

ID:	281171
PubChem CID:	103911256
Reduced:	NO2C7H10 (2)
Stoich.:	AB2C7D10 (2)
Weight, g/mol:	262.168128
ΔH_f, kcal/mol:	-81.89
Dipole, Da:	6.64
IP(EA), eV:	-9.69(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methyloxan-4-yl)amino]-N-phenylpropanamide

Drug info:

PubChemData

Smile

CC1CC(CCO1)NCCOC2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations