Geometry & MOs

Info

ID:	384140
PubChem CID:	134976412
Reduced:	NO2C27H29 (1)
Stoich.:	AB2C27D29 (1)
Weight, g/mol:	418.010722
ΔH_f, kcal/mol:	-30.93
Dipole, Da:	3.95
IP(EA), eV:	-8.98(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CC(C(=O)OC(C)(C)C)N=C(C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations