Geometry & MOs

Info

ID:	227126
PubChem CID:	87560298
Reduced:	ClO2N6H25C27 (1)
Stoich.:	AB2C6D25E27 (1)
Weight, g/mol:	115.063329
ΔH_f, kcal/mol:	116.51
Dipole, Da:	5.43
IP(EA), eV:	-8.81(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-(oxetan-2-yl)formamide

Drug info:

PubChemData

Smile

CC#CC(=NOCCNC)C1=CC2=C(C=C1)N=CN=C2NC3=CC(=C(C=C3)OCC4=CN=CC=C4)Cl

DOS

IR

Vibrations