Geometry & MOs

Info

ID:	74701
PubChem CID:	48422314
Reduced:	N3O5C17H27 (1)
Stoich.:	A3B5C17D27 (1)
Weight, g/mol:	343.05315
ΔH_f, kcal/mol:	-191.28
Dipole, Da:	3.33
IP(EA), eV:	-9.44(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N'-[2-(cyclopropylmethoxy)propanoyl]-1-methylpyrrole-2-carbohydrazide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCN(CC1)C(=O)C(=O)N2CCOCC2)OCC3CC3

DOS

IR

Vibrations