Geometry & MOs

Info

ID:	313027
PubChem CID:	126610800
Reduced:	N3O6C20H25 (1)
Stoich.:	A3B6C20D25 (1)
Weight, g/mol:	556.2897
ΔH_f, kcal/mol:	-151.56
Dipole, Da:	7.21
IP(EA), eV:	-8.7(-1.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-methoxy-5-[(3,4,5-trimethoxyphenyl)diazenyl]phenyl] 2-[(4-methylpentanoylamino)methyl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)/N=C/1\C=C(C=CC1=O)NNC2=CC(=C(C(=C2)OC)OC)OC

DOS

IR

Vibrations