Geometry & MOs

Info

ID:	164246
PubChem CID:	74382551
Reduced:	F2O3N5C20H31 (1)
Stoich.:	A2B3C5D20E31 (1)
Weight, g/mol:	266.163043
ΔH_f, kcal/mol:	-225.38
Dipole, Da:	4.03
IP(EA), eV:	-9.36(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(dimethylamino)propyl 4-amino-2-ethoxybenzoate

Drug info:

PubChemData

Smile

CC1(CNC2(CCN(CC2)C(=O)NC(CC(C)(F)F)C(=O)NC3(CC3)C#N)OC1)C

DOS

IR

Vibrations