Geometry & MOs

Info

ID:	172113
PubChem CID:	75468739
Reduced:	IOSN5C14H26 (1)
Stoich.:	ABCD5E14F26 (1)
Weight, g/mol:	311.177982
ΔH_f, kcal/mol:	-27.93
Dipole, Da:	4.49
IP(EA), eV:	-8.87(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-N-ethylcarbamimidoyl]amino]-N,N-dimethylpropanamide

Drug info:

PubChemData

Smile

CCNC(=NCC1=C(N=C(S1)C)C)NCCC(=O)N(C)C.I

DOS

IR

Vibrations