Geometry & MOs

Info

ID:	287702
PubChem CID:	104252346
Reduced:	NOC14H25 (1)
Stoich.:	ABC14D25 (1)
Weight, g/mol:	199.193614
ΔH_f, kcal/mol:	-48.16
Dipole, Da:	2.31
IP(EA), eV:	-8.83(1.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(oxan-2-yl)-N-propylbutan-2-amine

Drug info:

PubChemData

Smile

CCCNC(CC#CC)CC1CCCCO1

DOS

IR

Vibrations