Geometry & MOs

Info

ID:	273702
PubChem CID:	103771838
Reduced:	N2O5C13H16 (1)
Stoich.:	A2B5C13D16 (1)
Weight, g/mol:	188.152478
ΔH_f, kcal/mol:	-99.55
Dipole, Da:	7.99
IP(EA), eV:	-10.09(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-3-(1-hydroxy-3-methylpentan-3-yl)urea

Drug info:

PubChemData

Smile

CC(=C)COCCNC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])O

DOS

IR

Vibrations