Geometry & MOs

Info

ID:	255411
PubChem CID:	103131872
Reduced:	NOC17H27 (1)
Stoich.:	ABC17D27 (1)
Weight, g/mol:	171.162314
ΔH_f, kcal/mol:	-54.31
Dipole, Da:	1.71
IP(EA), eV:	-8.95(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-(5-methyloxolan-2-yl)butan-1-amine

Drug info:

PubChemData

Smile

CCNC(CCCC1CCC(O1)C)C2=CC=CC=C2

DOS

IR

Vibrations