Geometry & MOs

Info

ID:	156459
PubChem CID:	56370715
Reduced:	N4O5C22H26 (1)
Stoich.:	A4B5C22D26 (1)
Weight, g/mol:	373.182398
ΔH_f, kcal/mol:	-101.26
Dipole, Da:	4.43
IP(EA), eV:	-8.09(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cycloheptylpyrrolidin-3-yl)-5-methyl-2-thiophen-2-yl-1,3-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(CC(=O)NC1=CC(=CC=C1)N2CCCC2)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations