Geometry & MOs

Info

ID:	20743
PubChem CID:	585464
Reduced:	NC13H18 (2)
Stoich.:	AB13C18 (2)
Weight, g/mol:	376.287849
ΔH_f, kcal/mol:	-38.41
Dipole, Da:	2.15
IP(EA), eV:	-7.75(0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N,3-N-bis(1-adamantyl)benzene-1,3-diamine

Drug info:

PubChemData

Smile

C1C2CC3CC1CC(C2)(C3)NC4=CC(=CC=C4)NC56CC7CC(C5)CC(C7)C6

DOS

IR

Vibrations