Geometry & MOs

Info

ID:	147168
PubChem CID:	53786821
Reduced:	NO7C43H43 (1)
Stoich.:	AB7C43D43 (1)
Weight, g/mol:	326.163043
ΔH_f, kcal/mol:	-232.2
Dipole, Da:	2.93
IP(EA), eV:	-8.98(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-ethyl-N-[2-[(1-phenylethylideneamino)oxymethyl]phenyl]carbamate

Drug info:

PubChemData

Smile

CC(C(CC1=CC=CC(=C1)CCC2=CC=CC=C2)C3=CC=C(C=C3)C(=O)OC)N(CC4=CC5=CC=CC=C5C=C4)C(=O)C[C@H](CC(=O)O)C(=O)O

DOS

IR

Vibrations