Geometry & MOs

Info

ID:	177092
PubChem CID:	76134382
Reduced:	ON2C11H16 (1)
Stoich.:	AB2C11D16 (1)
Weight, g/mol:	200.116092
ΔH_f, kcal/mol:	45.41
Dipole, Da:	3.47
IP(EA), eV:	-8.51(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-amino-3-hydroxybutanoyl)pyrrolidine-2-carbaldehyde

Drug info:

PubChemData

Smile

CC(=CC=C1CON=C1N(C)C)C=C

DOS

IR

Vibrations