Geometry & MOs

Info

ID:	77443
PubChem CID:	49635571
Reduced:	O3N4C20H28 (1)
Stoich.:	A3B4C20D28 (1)
Weight, g/mol:	370.211724
ΔH_f, kcal/mol:	-90.21
Dipole, Da:	5.02
IP(EA), eV:	-8.64(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-3-[4-[1-[2-(2-methylimidazol-1-yl)ethylcarbamoylamino]ethyl]phenyl]urea

Drug info:

PubChemData

Smile

CC1=NC=CN1CCNC(=O)NCC2=CC(=C(C=C2)OC3CCCC3)OC

DOS

IR

Vibrations