Geometry & MOs

Info

ID:	448753
PubChem CID:	135293312
Reduced:	OF4N5C19H19 (1)
Stoich.:	AB4C5D19E19 (1)
Weight, g/mol:	493.130792
ΔH_f, kcal/mol:	-93.06
Dipole, Da:	6.53
IP(EA), eV:	-8.23(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[amino-[2-amino-3-[5-[(5-cyanothiophen-2-yl)methoxy]pyridin-2-yl]-2-(2,4-difluorophenyl)-3,3-difluoropropyl]amino]methanimidamide

Drug info:

PubChemData

Smile

CC#CCOC1=CN=C(C=C1)C(C(CN(N)/N=C\N)C2=C(C=C(C=C2)F)F)(F)F

DOS

IR

Vibrations