Geometry & MOs

Info

ID:	340198
PubChem CID:	127262207
Reduced:	NOC9H11 (2)
Stoich.:	ABC9D11 (2)
Weight, g/mol:	202.131742
ΔH_f, kcal/mol:	-76.45
Dipole, Da:	2.63
IP(EA), eV:	-8.25(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N'-[(Z)-3,5-dihydroxyhept-4-en-3-yl]carbamimidate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCC1=C(C=CC(=C1)C2=CC=CC=C2)N

DOS

IR

Vibrations