Geometry & MOs

Info

ID:	158934
PubChem CID:	57244235
Reduced:	BrSN4O4C16H17 (1)
Stoich.:	ABC4D4E16F17 (1)
Weight, g/mol:	198.068391
ΔH_f, kcal/mol:	-119.79
Dipole, Da:	4.17
IP(EA), eV:	-8.68(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(4-aminophenyl)methyl-ethoxy-oxophosphanium

Drug info:

PubChemData

Smile

CCOC(=O)CC1=CSC(N1CC2=C3C(=CC(=C2)Br)NC(=O)C(=O)N3)N

DOS

IR

Vibrations