Geometry & MOs

Info

ID:	272099
PubChem CID:	103723884
Reduced:	N2O3C17H32 (1)
Stoich.:	A2B3C17D32 (1)
Weight, g/mol:	197.098669
ΔH_f, kcal/mol:	-186.6
Dipole, Da:	4.75
IP(EA), eV:	-9.25(0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-3-[(1-methylpyrrol-3-yl)methyl]thiourea

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCCC1C2CCCCC2NCCO

DOS

IR

Vibrations