Geometry & MOs

Info

ID:	6499
PubChem CID:	68770
Reduced:	N3O3C20H33 (1)
Stoich.:	A3B3C20D33 (1)
Weight, g/mol:	363.252192
ΔH_f, kcal/mol:	-151.4
Dipole, Da:	4.7
IP(EA), eV:	-8.36(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-3-cyclohexylurea

Drug info:

PubChemData

Smile

CC(C)(C)NCC(COC1=CC=C(C=C1)NC(=O)NC2CCCCC2)O

DOS

IR

Vibrations