Geometry & MOs

Info

ID:	247603
PubChem CID:	103072377
Reduced:	ON2C9H16 (1)
Stoich.:	AB2C9D16 (1)
Weight, g/mol:	224.188863
ΔH_f, kcal/mol:	-42.59
Dipole, Da:	4.69
IP(EA), eV:	-9.26(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[(tert-butylamino)methyl]prop-2-enyl]-4-methylpyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1CC(=O)N(C1)CC(=C)CN

DOS

IR

Vibrations