Geometry & MOs

Info

ID:	429508
PubChem CID:	135169557
Reduced:	NC7H11 (2)
Stoich.:	AB7C11 (2)
Weight, g/mol:	322.240899
ΔH_f, kcal/mol:	-10.49
Dipole, Da:	3.64
IP(EA), eV:	-7.98(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-tert-butyl-6-(2-methyl-2-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine

Drug info:

PubChemData

Smile

CCC(C)(C)NC1=CC2=C(CNCC2)C=C1

DOS

IR

Vibrations