Geometry & MOs

Info

ID:	427324
PubChem CID:	135157189
Reduced:	BrN2O3C18H27 (1)
Stoich.:	AB2C3D18E27 (1)
Weight, g/mol:	212.131349
ΔH_f, kcal/mol:	-132.4
Dipole, Da:	1.57
IP(EA), eV:	-8.07(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-naphthalen-1-ylpyrrolidin-1-amine

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)OCCCBr

DOS

IR

Vibrations