Geometry & MOs

Info

ID:	289828
PubChem CID:	104377001
Reduced:	N5C11H17 (1)
Stoich.:	A5B11C17 (1)
Weight, g/mol:	264.256549
ΔH_f, kcal/mol:	56.41
Dipole, Da:	6.48
IP(EA), eV:	-9.25(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-(3,5-dimethyl-1-adamantyl)ethyl]-N-methylethane-1,2-diamine

Drug info:

PubChemData

Smile

CC1=NC2=NC=CC(=C2N1)CNCCNC

DOS

IR

Vibrations