Geometry & MOs

Info

ID:	203062
PubChem CID:	79772205
Reduced:	SN3C10H17 (1)
Stoich.:	AB3C10D17 (1)
Weight, g/mol:	306.058276
ΔH_f, kcal/mol:	41.23
Dipole, Da:	1.81
IP(EA), eV:	-8.75(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloroethyl)-2,6-difluoro-3-nitro-N-propylbenzamide

Drug info:

PubChemData

Smile

CCCN(CC1=CN=C(S1)N)C2CC2

DOS

IR

Vibrations