Geometry & MOs

Info

ID:	220039
PubChem CID:	85165174
Reduced:	O7N8H30C32 (1)
Stoich.:	A7B8C30D32 (1)
Weight, g/mol:	638.477106
ΔH_f, kcal/mol:	-81.19
Dipole, Da:	7.91
IP(EA), eV:	-8.98(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[4-[bis(2,6,10-trimethylundeca-2,4,9-trienoylamino)methylideneamino]butyl]carbamate

Drug info:

PubChemData

Smile

CN(C)C1=NN2C(=NN=C2C(=N1)NN)C3C(C(C(O3)COC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6

DOS

IR

Vibrations