Geometry & MOs

Info

ID:	435850
PubChem CID:	135192569
Reduced:	N7O8C37H61 (1)
Stoich.:	A7B8C37D61 (1)
Weight, g/mol:	170.178299
ΔH_f, kcal/mol:	-416.86
Dipole, Da:	12.84
IP(EA), eV:	-8.7(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,6,8-trimethyl-1,5-diazonane

Drug info:

PubChemData

Smile

CCC(C)(CC)C1CC(N(C1=O)CCCCCC(=O)NCC(=O)NCC(=O)NC(C[C@H]2CC=CC=C2)C(=O)NCC(=O)NCCCCCC(=O)N)O

DOS

IR

Vibrations