Geometry & MOs

Info

ID:	139678
PubChem CID:	52578923
Reduced:	O3N6C25H26 (1)
Stoich.:	A3B6C25D26 (1)
Weight, g/mol:	235.157229
ΔH_f, kcal/mol:	-7.34
Dipole, Da:	5.19
IP(EA), eV:	-9.25(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-N-[3-(methoxymethyl)phenyl]butanamide

Drug info:

PubChemData

Smile

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=C(N(N=C3)C4=CC=C(C=C4)C)C(C)C

DOS

IR

Vibrations