Geometry & MOs

Info

ID:	342743
PubChem CID:	127265906
Reduced:	OSN5H13C17 (1)
Stoich.:	ABC5D13E17 (1)
Weight, g/mol:	255.118318
ΔH_f, kcal/mol:	126.31
Dipole, Da:	5.04
IP(EA), eV:	-8.98(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyclopropyl-2,2-difluoroethyl)-3-(6-methylpyridin-2-yl)urea

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2=NC(=NC=C2)C=CC3=CN=C(S3)C4=CC=CO4

DOS

IR

Vibrations