Geometry & MOs

Info

ID:	69584
PubChem CID:	47193881
Reduced:	O2N3C15H21 (1)
Stoich.:	A2B3C15D21 (1)
Weight, g/mol:	246.173213
ΔH_f, kcal/mol:	-45.65
Dipole, Da:	4.19
IP(EA), eV:	-7.98(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-methylcyclopropyl)methyl]-3-(4-propan-2-ylphenyl)urea

Drug info:

PubChemData

Smile

C1CC1CNC(=O)NC2=CC=C(C=C2)N3CCOCC3

DOS

IR

Vibrations