Geometry & MOs

Info

ID:	216811
PubChem CID:	85086812
Reduced:	O2C9H12 (2)
Stoich.:	A2B9C12 (2)
Weight, g/mol:	304.178693
ΔH_f, kcal/mol:	-164.74
Dipole, Da:	1.88
IP(EA), eV:	-8.66(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(3-butoxy-4-methoxyphenyl)-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one

Drug info:

PubChemData

Smile

CC1C(C=CC(O1)OC2=CC=C(C=C2)C(C)(C)C)OC(=O)C

DOS

IR

Vibrations