Geometry & MOs

Info

ID:	384430
PubChem CID:	134976969
Reduced:	N2P3C12O15H19 (1)
Stoich.:	A2B3C12D15E19 (1)
Weight, g/mol:	189.091866
ΔH_f, kcal/mol:	-840.61
Dipole, Da:	5.12
IP(EA), eV:	-9.86(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[ethoxy(methyl)phosphoryl]-N-ethylprop-2-yn-1-amine

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1=O)[C@H]2CO[C@H]([C@@H]2OC(=O)C)COP(=O)(O)OP(=O)(O)OP(=O)(O)O

DOS

IR

Vibrations