Geometry & MOs

Info

ID:	391168
PubChem CID:	135003326
Reduced:	NO5C21H25 (1)
Stoich.:	AB5C21D25 (1)
Weight, g/mol:	548.112329
ΔH_f, kcal/mol:	-188.37
Dipole, Da:	6.46
IP(EA), eV:	-8.45(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N,4-N-bis[(Z)-2-chloro-2-di(propan-2-yloxy)phosphorylethenyl]-1,2,5-oxadiazole-3,4-diamine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=C(C(=C(O2)NC3CCCCC3)C(=O)OC)C(=O)OC

DOS

IR

Vibrations