Geometry & MOs

Info

ID:	144927
PubChem CID:	53433417
Reduced:	NOSC8H9 (2)
Stoich.:	ABCD8E9 (2)
Weight, g/mol:	312.183778
ΔH_f, kcal/mol:	-35.98
Dipole, Da:	3.47
IP(EA), eV:	-8.9(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-tert-butyl-1,2-oxazol-3-yl)-N-(2-phenylcyclopentyl)formamide

Drug info:

PubChemData

Smile

CC(C)CC1CC2=C(C(=O)C1)SC(=N2)N(C=O)C3=CC=CS3

DOS

IR

Vibrations