Geometry & MOs

Info

ID:	193812
PubChem CID:	78441133
Reduced:	N2O3C22H28 (1)
Stoich.:	A2B3C22D28 (1)
Weight, g/mol:	348.204907
ΔH_f, kcal/mol:	-123.84
Dipole, Da:	4.11
IP(EA), eV:	-9.54(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl] 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate

Drug info:

PubChemData

Smile

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OC(C)C(=O)NC3CCCCC3

DOS

IR

Vibrations