Geometry & MOs

Info

ID:	387761
PubChem CID:	134986767
Reduced:	ClOSC10H19 (1)
Stoich.:	ABCD10E19 (1)
Weight, g/mol:	256.030082
ΔH_f, kcal/mol:	-85.91
Dipole, Da:	0.73
IP(EA), eV:	-9.04(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-1,1,1-trichloro-4-methyl-N-(propan-2-ylideneamino)pentan-3-imine

Drug info:

PubChemData

Smile

CCCCC(C(=O)CC)(SCC)Cl

DOS

IR

Vibrations