Geometry & MOs

Info

ID:	31746
PubChem CID:	3288098
Reduced:	N2O2C27H34 (1)
Stoich.:	A2B2C27D34 (1)
Weight, g/mol:	406.225643
ΔH_f, kcal/mol:	-44.46
Dipole, Da:	4.75
IP(EA), eV:	-8.6(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-benzylpyrrol-2-yl)methyl]-N-butyl-2,6-dimethoxybenzamide

Drug info:

PubChemData

Smile

CCCCN(CC1=CC=CN1CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)OCCCC

DOS

IR

Vibrations