Geometry & MOs

Info

ID:	428480
PubChem CID:	135167426
Reduced:	NOH25C36 (1)
Stoich.:	ABC25D36 (1)
Weight, g/mol:	197.21435
ΔH_f, kcal/mol:	119.34
Dipole, Da:	2.48
IP(EA), eV:	-8.06(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-1,2-ditert-butyl-4-methylpyrrolidine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3NC4=CC=C(C=C4)C5=CC6=C(C=C5)OC7=CC=CC=C76

DOS

IR

Vibrations