Geometry & MOs

Info

ID:	297445
PubChem CID:	117617775
Reduced:	NC17H19 (2)
Stoich.:	AB17C19 (2)
Weight, g/mol:	143.069477
ΔH_f, kcal/mol:	66.45
Dipole, Da:	3.13
IP(EA), eV:	-8.08(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(methylideneamino) N-acetyl-N'-methylcarbamimidate

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)N=CN(C2=C(C=C(C=C2C)C)C)[C@H](C3=CC=CC=C3)[C@H](C)C4=CC=CC=C4)C

DOS

IR

Vibrations