Geometry & MOs

Info

ID:	399319
PubChem CID:	135039624
Reduced:	OC16H30 (1)
Stoich.:	AB16C30 (1)
Weight, g/mol:	244.160935
ΔH_f, kcal/mol:	-92.57
Dipole, Da:	2.27
IP(EA), eV:	-9.64(1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-4-(butylamino)-4-sulfanylidenebutanamide

Drug info:

PubChemData

Smile

CCCCC\1(CCCCCCCCC/C=C1)O

DOS

IR

Vibrations