Geometry & MOs

Info

ID:	343381
PubChem CID:	127266554
Reduced:	ON6C17H18 (1)
Stoich.:	AB6C17D18 (1)
Weight, g/mol:	331.149619
ΔH_f, kcal/mol:	79.37
Dipole, Da:	0.98
IP(EA), eV:	-9.15(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-3-(2,2-difluoro-1-phenylethyl)-1-(pyridin-4-ylmethyl)urea

Drug info:

PubChemData

Smile

CC1=C(C2=NC=NN2C=C1)NC(=O)N(CC3=CC=NC=C3)C4CC4

DOS

IR

Vibrations