Geometry & MOs

Info

ID:	287701
PubChem CID:	104252338
Reduced:	NOC11H23 (1)
Stoich.:	ABC11D23 (1)
Weight, g/mol:	223.193614
ΔH_f, kcal/mol:	-82.17
Dipole, Da:	1.46
IP(EA), eV:	-8.58(2.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(oxan-2-yl)-N-propylhex-4-yn-2-amine

Drug info:

PubChemData

Smile

CCCNC(C)CC1CCCCO1

DOS

IR

Vibrations