Geometry & MOs

Info

ID:	419661
PubChem CID:	135108676
Reduced:	O3N4C24H28 (1)
Stoich.:	A3B4C24D28 (1)
Weight, g/mol:	375.198048
ΔH_f, kcal/mol:	-52.35
Dipole, Da:	5.02
IP(EA), eV:	-8.46(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4aS,8aS)-1-[(5-methylfuran-2-yl)methyl]-7-[(4-methyl-1,3-thiazol-5-yl)methyl]-3,4,5,6,8,8a-hexahydro-2H-1,7-naphthyridin-4a-yl]methanol

Drug info:

PubChemData

Smile

CC1=C(OC2=C1C=CC(=C2)OC)C(=O)N3CCCC4(C3)CCC5=CN=C(N=C45)N(C)C

DOS

IR

Vibrations