Geometry & MOs

Info

ID:	431102
PubChem CID:	135171172
Reduced:	N3O4C30H43 (1)
Stoich.:	A3B4C30D43 (1)
Weight, g/mol:	219.96698
ΔH_f, kcal/mol:	-183.02
Dipole, Da:	4.27
IP(EA), eV:	-8.74(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-bromoethanimidoyl) cyclopropanecarboximidothioate

Drug info:

PubChemData

Smile

CCN([C@H]1CCC[C@H](C1)N(CC2=CC=CC=C2)C(=O)OC(C)(C)C)C(=O)C3=CC4=C(N3)CC(OC4)(C)C

DOS

IR

Vibrations