Geometry & MOs

Info

ID:	171728
PubChem CID:	75418425
Reduced:	ClO2N3C19H28 (1)
Stoich.:	AB2C3D19E28 (1)
Weight, g/mol:	328.142307
ΔH_f, kcal/mol:	-129.79
Dipole, Da:	2.11
IP(EA), eV:	-8.8(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4,5-dimethyl-1,3-oxazol-2-yl)methyl 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)CC3CCCC3)N.Cl

DOS

IR

Vibrations