Geometry & MOs

Info

ID:	430072
PubChem CID:	135170129
Reduced:	NO2C16H25 (1)
Stoich.:	AB2C16D25 (1)
Weight, g/mol:	386.210661
ΔH_f, kcal/mol:	-116.41
Dipole, Da:	2.49
IP(EA), eV:	-8.2(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(E)-(4-methyl-4-azatricyclo[4.3.1.13,8]undecan-5-ylidene)methyl]imino-5H-1,10-phenanthrolin-5-ol

Drug info:

PubChemData

Smile

CCC(CC(C)C)C(=O)NC1=CC(=C(C(=C1)C)O)C

DOS

IR

Vibrations