Geometry & MOs

Info

ID:	431086
PubChem CID:	135171156
Reduced:	ClSN3O4C22H26 (1)
Stoich.:	ABC3D4E22F26 (1)
Weight, g/mol:	177.97418
ΔH_f, kcal/mol:	-16.12
Dipole, Da:	3.87
IP(EA), eV:	-8.58(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethanimidoyl 2-bromoethanimidate

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)Cl)SNC2=CC3=C(N=C2)OC[C@H]4C(CCCC(=O)N4C3)CCO

DOS

IR

Vibrations