Geometry & MOs

Info

ID:	228428
PubChem CID:	87564406
Reduced:	OS2N6H14C16 (1)
Stoich.:	AB2C6D14E16 (1)
Weight, g/mol:	254.139544
ΔH_f, kcal/mol:	116.36
Dipole, Da:	7.34
IP(EA), eV:	-8.65(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

aminophosphonic acid;N,N-diethyl-3-methylbutanamide

Drug info:

PubChemData

Smile

C1CC(C1)OC2=NN3C(=NN=C3SC4=CC5=C(C=C4)N=C(S5)N)C=C2

DOS

IR

Vibrations