Geometry & MOs

Info

ID:	196669
PubChem CID:	78862136
Reduced:	ClO2N3C15H16 (1)
Stoich.:	AB2C3D15E16 (1)
Weight, g/mol:	302.0266
ΔH_f, kcal/mol:	-39.11
Dipole, Da:	2.77
IP(EA), eV:	-9.42(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2,5-dimethyl-N'-(2-methylpropanoyl)furan-3-carbohydrazide

Drug info:

PubChemData

Smile

C1CN(CCC1O)C(=O)C2=CC(=NN2)C3=CC=CC=C3Cl

DOS

IR

Vibrations