Geometry & MOs

Info

ID:	173937
PubChem CID:	75703008
Reduced:	N2O5C31H48 (1)
Stoich.:	A2B5C31D48 (1)
Weight, g/mol:	472.293722
ΔH_f, kcal/mol:	-215.19
Dipole, Da:	6.53
IP(EA), eV:	-8.59(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(butylamino)-1-(3,4-dimethoxyphenyl)-2-oxoethyl]-2-ethyl-N-(furan-2-ylmethyl)hexanamide

Drug info:

PubChemData

Smile

CCCCC(CC)C(=O)N(CC1=CC=CO1)C(C2=CC(=C(C=C2)OC)OC)C(=O)NC(C)(C)CC(C)(C)C

DOS

IR

Vibrations