Geometry & MOs

Info

ID:	265702
PubChem CID:	103540543
Reduced:	BrN3O3C14H20 (1)
Stoich.:	AB3C3D14E20 (1)
Weight, g/mol:	270.132805
ΔH_f, kcal/mol:	-79.92
Dipole, Da:	5.12
IP(EA), eV:	-9.09(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3,4-dimethoxypyrrolidin-1-yl)methyl]-1,2-oxazole-3-carbohydrazide

Drug info:

PubChemData

Smile

COC1CN(CC1OC)CC2=C(C=C(C=C2)C(=O)NN)Br

DOS

IR

Vibrations