Geometry & MOs

Info

ID:	433469
PubChem CID:	135173606
Reduced:	SN4O4C24H28 (1)
Stoich.:	AB4C4D24E28 (1)
Weight, g/mol:	299.03823
ΔH_f, kcal/mol:	-79.95
Dipole, Da:	5.43
IP(EA), eV:	-9.35(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(Z)-4-(2-iodopropoxy)but-2-enoxy]ethanamine

Drug info:

PubChemData

Smile

CC1=C(SC=N1)C2=CC=C(C=C2)CNC(=O)C3CC(CN3C(=O)C(C4=CC=NO4)C(C)C)O

DOS

IR

Vibrations