Geometry & MOs

Info

ID:	434398
PubChem CID:	135174841
Reduced:	NO2C7H7 (2)
Stoich.:	AB2C7D7 (2)
Weight, g/mol:	228.220164
ΔH_f, kcal/mol:	-155.28
Dipole, Da:	7.64
IP(EA), eV:	-10.3(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-tert-butyl-1-(2-propan-2-yloxyethyl)pyrrolidin-3-amine

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)C(=O)N(C2=O)C3CCC(=O)NC3O

DOS

IR

Vibrations