Geometry & MOs

Info

ID:	424778
PubChem CID:	135123886
Reduced:	N3O4C30H35 (1)
Stoich.:	A3B4C30D35 (1)
Weight, g/mol:	120.02834
ΔH_f, kcal/mol:	-81.98
Dipole, Da:	9.07
IP(EA), eV:	-8.75(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-amino-1-nitrourea

Drug info:

PubChemData

Smile

CCN1C2=C(C(=C(C=C2)C(C3=CC(=C(C=C3)C)COCC4=CC=C(C=C4)OC)C(C)(C)C(=O)O)C)N=N1

DOS

IR

Vibrations