Geometry & MOs

Info

ID:	435914
PubChem CID:	135192758
Reduced:	O2F3N4C23H29 (1)
Stoich.:	A2B3C4D23E29 (1)
Weight, g/mol:	310.179361
ΔH_f, kcal/mol:	-150.2
Dipole, Da:	4.41
IP(EA), eV:	-9.07(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(6-amino-5-methylpyridin-3-yl)-1-(1-bicyclo[1.1.1]pentanyl)imidazol-2-yl]-cyclopropylmethanol

Drug info:

PubChemData

Smile

CC1=C(C=C(C=N1)C2=CN(C(=N2)C(C(C)C)O)C34CC(C3)(C4)N5CCOCC5)C(F)(F)F

DOS

IR

Vibrations