Geometry & MOs

Info

ID:	47719
PubChem CID:	10534901
Reduced:	NOSC7H9 (1)
Stoich.:	ABCD7E9 (1)
Weight, g/mol:	155.131014
ΔH_f, kcal/mol:	11.27
Dipole, Da:	1.96
IP(EA), eV:	-8.88(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-dimethyl-5-propan-2-yl-2,4-dihydropyrrol-2-ol

Drug info:

PubChemData

Smile

CC1=C(SC=C1)/C(=N/O)/C

DOS

IR

Vibrations