Geometry & MOs

Info

ID:	323884
PubChem CID:	126676437
Reduced:	N7C19H19 (1)
Stoich.:	A7B19C19 (1)
Weight, g/mol:	476.249807
ΔH_f, kcal/mol:	146.59
Dipole, Da:	2.56
IP(EA), eV:	-9.06(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R,2S,8S)-10-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(3,3,3-trifluoropropanoyl)-4-azatricyclo[4.4.1.03,8]undecan-2-yl] 2,2-dimethylpropanoate

Drug info:

PubChemData

Smile

C1C(CC2=CC=CC=C21)CN3C=C(C=N3)CC4=CC(=NC5=NNN=C45)N

DOS

IR

Vibrations