Geometry & MOs

Info

ID:	74154
PubChem CID:	48421523
Reduced:	N3O5C16H27 (1)
Stoich.:	A3B5C16D27 (1)
Weight, g/mol:	378.201553
ΔH_f, kcal/mol:	-200.84
Dipole, Da:	5.89
IP(EA), eV:	-8.76(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-hydroxy-3-(2-propan-2-yloxyethoxy)propyl]-1-methyl-3-[6-(1,2,4-triazol-1-yl)pyridin-3-yl]urea

Drug info:

PubChemData

Smile

CC(C)OCCOCC(CN(C)C(=O)NC1=C(N=CC=C1)OC)O

DOS

IR

Vibrations