Geometry & MOs

Info

ID:	188846
PubChem CID:	77773958
Reduced:	O2N5C28H49 (1)
Stoich.:	A2B5C28D49 (1)
Weight, g/mol:	138.03534
ΔH_f, kcal/mol:	-62.87
Dipole, Da:	3.6
IP(EA), eV:	-8.56(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(=CC1CCC2(C1(CCC3C2CCC4C3(CCC(C4)O)C)C)O)C=NNC(=NCCN(C)C)N

DOS

IR

Vibrations