Geometry & MOs

Info

ID:	340234
PubChem CID:	127262243
Reduced:	SN3O3H13C15 (1)
Stoich.:	AB3C3D13E15 (1)
Weight, g/mol:	344.132351
ΔH_f, kcal/mol:	35.88
Dipole, Da:	5.21
IP(EA), eV:	-9.35(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl N-diethoxyphosphoryl-N-phenylcarbamimidothioate

Drug info:

PubChemData

Smile

CSC(=N)N(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations