Geometry & MOs

Info

ID:	158219
PubChem CID:	56463177
Reduced:	N3O5C21H31 (1)
Stoich.:	A3B5C21D31 (1)
Weight, g/mol:	370.03506
ΔH_f, kcal/mol:	-177.97
Dipole, Da:	5.07
IP(EA), eV:	-8.54(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-bromofuran-2-yl)methyl]-N,4-dimethyl-2-(2-methylpropyl)-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C(=C(C=C1)CN2CCN(CC2)C(=O)CCN3CCCC3=O)OC)OC

DOS

IR

Vibrations