Geometry & MOs

Info

ID:	66083
PubChem CID:	46491042
Reduced:	SN4O4C9H14 (1)
Stoich.:	AB4C4D9E14 (1)
Weight, g/mol:	430.05282
ΔH_f, kcal/mol:	-105.23
Dipole, Da:	4.42
IP(EA), eV:	-9.18(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[4-(2-bromophenoxy)butanoyl]-3-methyl-1-benzofuran-2-carbohydrazide

Drug info:

PubChemData

Smile

CCOC(=O)NNC(=O)CSCC1=NOC(=N1)C

DOS

IR

Vibrations