Geometry & MOs

Info

ID:	224823
PubChem CID:	85415732
Reduced:	C3H4 (20)
Stoich.:	A3B4 (20)
Weight, g/mol:	393.251523
ΔH_f, kcal/mol:	102.32
Dipole, Da:	2.44
IP(EA), eV:	-7.7(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ditert-butyl 4,4-bis(but-3-enyl)-5-oxopyrrolidine-1,2-dicarboxylate

Drug info:

PubChemData

Smile

CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C=CC=C(C)C=CC2=C(CCCC2(C)C)C)C)C)C)C

DOS

IR

Vibrations