Geometry & MOs

Info

ID:	51442
PubChem CID:	12014112
Reduced:	N3C10H22 (2)
Stoich.:	A3B10C22 (2)
Weight, g/mol:	422.409696
ΔH_f, kcal/mol:	19.29
Dipole, Da:	5.74
IP(EA), eV:	-8.59(1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,11R,16R,26R)-2,6,10,17,21,25-hexazatricyclo[24.4.0.011,16]triacontane

Drug info:

PubChemData

Smile

C1CC[C@@H]2[C@@H](C1)NCCCNCCCNCCNCCCNCCCN2

DOS

IR

Vibrations