Geometry & MOs

Info

ID:	309583
PubChem CID:	126549561
Reduced:	ON3C33H39 (1)
Stoich.:	AB3C33D39 (1)
Weight, g/mol:	146.051384
ΔH_f, kcal/mol:	20.69
Dipole, Da:	5.69
IP(EA), eV:	-8.18(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propyl N'-formylcarbamimidothioate

Drug info:

PubChemData

Smile

CC1=C(N(C2=C1C=C(C=C2)C(=O)N[C@@H](C)C3=CC=CC(=C3)C4CC4)CC5=CC=CC(=C5)CNC(C)C)C

DOS

IR

Vibrations