Geometry & MOs

Info

ID:	201453
PubChem CID:	79541002
Reduced:	NO2C18H31 (1)
Stoich.:	AB2C18D31 (1)
Weight, g/mol:	198.209599
ΔH_f, kcal/mol:	-120.65
Dipole, Da:	3.26
IP(EA), eV:	-8.52(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-(1-pyrrolidin-2-ylpropan-2-yl)butan-1-amine

Drug info:

PubChemData

Smile

COC1CCCC(C1)N2CCCCC2C3CCCCC3=O

DOS

IR

Vibrations