Geometry & MOs

Info

ID:	373835
PubChem CID:	131320502
Reduced:	INOH8C11 (1)
Stoich.:	ABCD8E11 (1)
Weight, g/mol:	128.058578
ΔH_f, kcal/mol:	22.98
Dipole, Da:	4.28
IP(EA), eV:	-9.94(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyano-N-(2-hydroxypropyl)formamide

Drug info:

PubChemData

Smile

C1CC2=C(CC1=O)C(=C(C=C2)C#N)I

DOS

IR

Vibrations